CID 10751321

187401-16-7

Structural Information

Molecular Formula
C13H18N2O
SMILES
CC1(CCC(C2=NC(=CN=C21)C=O)(C)C)C
InChI
InChI=1S/C13H18N2O/c1-12(2)5-6-13(3,4)11-10(12)14-7-9(8-16)15-11/h7-8H,5-6H2,1-4H3
InChIKey
JYUBFGIHUCBSRM-UHFFFAOYSA-N
Compound name
5,5,8,8-tetramethyl-6,7-dihydroquinoxaline-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

218.1419 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.149176 148.1
[M+Na]+ 241.131118 158.3
[M-H]- 217.134624 150.4
[M+NH4]+ 236.175723 169.6
[M+K]+ 257.105058 155.3
[M+H-H2O]+ 201.139160 141.4
[M+HCOO]- 263.140101 166.2
[M+CH3COO]- 277.155751 190.7
[M+Na-2H]- 239.116566 155.6
[M]+ 218.14135142 149.0
[M]- 218.14244858 149.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe